Development of UV-Chemometric techniques for resolving the overlapped spectra of aspirin, caffeine and orphenadrine citrate in their combined pharmaceutical dosage form

IF 4.3 2区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY
Sobhy M. El-Adl, Amr A. Mattar, Omar M. El-Abassy, Mahmoud M. Sebaiy
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引用次数: 0

Abstract

A UV-chemometric approach has been developed to analyze a ternary combination of aspirin, caffeine, and orphenadrine citrate without the need for previous separation. The method is easy, specific, accurate, and highly precise. The three medications were evaluated simultaneously utilizing CLS, PLS, and PCR, which were generated based on separate data sets that yielded superior findings. Regrettably, their accurate estimation could only be achieved using the PLS approach. In order to determine the prediction power of each chemometric approach, its validity has been tested using 8 synthetic mixes. The latent variable number varies across various models as the dataset changes. The comparison of various methodologies and the assessment of the predictive capacity of each set of data were done using the predicted residual error sum of squares (PRESS) and the root mean square error of prediction (RMSEP). The created approach was also used to statistically compare the performance of PLS in a dataset with zero absorption, as well as to compare the performance of the offered chemometric methods in various datasets. The environmental impact of the created approach was assessed to determine the overall ecological sustainability of the designed methodology. According to the new Blue Applicability Grade Index (BAGI) evaluation methodology, the suggested technique was also found to be practicable.

建立阿司匹林、咖啡因和枸橼酸奥非那林复合剂型中重叠光谱的紫外化学测定技术
一种紫外化学计量方法已被开发用于分析阿司匹林、咖啡因和枸橼酸奥非那林的三元组合,而不需要事先分离。该方法简便、特异、准确、精密度高。同时使用CLS, PLS和PCR对这三种药物进行评估,这三种药物是基于不同的数据集产生的,这些数据集产生了更好的结果。遗憾的是,它们的准确估计只能使用PLS方法来实现。为了确定每种化学计量方法的预测能力,使用8种合成混合物对其有效性进行了测试。随着数据集的变化,不同模型的潜在变量数也会变化。使用预测残差平方和(PRESS)和预测均方根误差(RMSEP)对各种方法进行比较,并对每组数据的预测能力进行评估。所创建的方法还用于统计比较PLS在零吸收数据集中的性能,以及比较所提供的化学计量方法在各种数据集中的性能。评估了所创建方法的环境影响,以确定所设计方法的整体生态可持续性。根据新的蓝色适用性等级指数(BAGI)评价方法,建议的技术也被发现是可行的。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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来源期刊
BMC Chemistry
BMC Chemistry Chemistry-General Chemistry
CiteScore
5.30
自引率
2.20%
发文量
92
审稿时长
27 weeks
期刊介绍: BMC Chemistry, formerly known as Chemistry Central Journal, is now part of the BMC series journals family. Chemistry Central Journal has served the chemistry community as a trusted open access resource for more than 10 years – and we are delighted to announce the next step on its journey. In January 2019 the journal has been renamed BMC Chemistry and now strengthens the BMC series footprint in the physical sciences by publishing quality articles and by pushing the boundaries of open chemistry.
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